4-bromo-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(piperidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
4-bromo-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(piperidine-1-sulfonyl)benzamide
4-bromo-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(piperidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | 8005-1654 |
| Compound Name: | 4-bromo-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(piperidine-1-sulfonyl)benzamide |
| Molecular Weight: | 494.43 |
| Molecular Formula: | C20 H20 Br N3 O3 S2 |
| Smiles: | C1CCN(CC1)S(c1cc(ccc1[Br])C(Nc1c(C#N)c2CCCc2s1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1238 |
| logD: | -0.0993 |
| logSw: | -4.3797 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.178 |
| InChI Key: | MXCAOYVUZGSJPG-UHFFFAOYSA-N |